| CAS Number | 56813-20-8 |
| Catalog Number | AG00EXD7(AGN-PC-0JWK0Q) |
| Chemical Name | 1H-Indole-2-carboxaldehyde, 6-methyl- (9CI) |
| IUPAC Name | 6-methyl-1H-indole-2-carbaldehyde |
| InChI | InChI=1S/C10H9NO/c1-7-2-3-8-5-9(6-12)11-10(8)4-7/h2-6,11H,1H3 |
| InChI Key | XOVLTOCIBJOEBK-UHFFFAOYSA-N |
| MDL Number | MFCD05863354 |
| Molecular Formula | C10H9NO |
| Molecular Weight | 159.1846 |
| SMILES | CC1=CC2=C(C=C(N2)C=O)C=C1 |
| Synonyms | 6-methyl-1H-indole-2-carbaldehyde,
56813-20-8,
AC1LGGNS,
1H-Indole-2-carboxaldehyde, 6-methyl- (9CI),
SCHEMBL5361224,
6-methylindole-2-carboxaldehyde,
CTK8C3495,
DTXSID10356262,
ZINC337615,
8315AB,
ANW-70170,
AJ-19858,
TC-158915,
6-METHYL-1H-INDOLE-2-CARBOXALDEHYDE,
ST24024427,
C10H9NO,
CID820975,
ZINC00337615,
1H-Indole-2-carboxaldehyde,6-methyl-,
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| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.188g/mol |
| Monoisotopic Mass | 159.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number